N-[3-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[3-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]phenyl]benzofuran-2-carboxamide CAS Name: N-[3-[[[[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[3-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[3-[[(E)-3-(4-chlorophenyl)acryloyl]thiocarbamoylamino]phenyl]coumarilamide Formula: C25H18ClN3O3S MolecularWeight: 475.94672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)NC3=CC(=CC=C3)NC(=S)NC(=O)C=CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)NC3=CC(=CC=C3)NC(=S)NC(=O)/C=C/C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H18ClN3O3S/c26-18-11-8-16(9-12-18)10-13-23(30)29-25(33)28-20-6-3-5-19(15-20)27-24(31)22-14-17-4-1-2-7-21(17)32-22/h1-15H,(H,27,31)(H2,28,29,30,33)/b13-10+